[HTML][HTML] Co-evolution techniques are reshaping the way we do structural bioinformatics

S de Oliveira, C Deane - F1000Research, 2017 - ncbi.nlm.nih.gov
Co-evolution techniques were originally conceived to assist in protein structure prediction by
inferring pairs of residues that share spatial proximity. However, the functional relationships …

[PDF][PDF] Applications of contact predictions to structural biology

F Simkovic, S Ovchinnikov, D Baker, DJ Rigden - IUCrJ, 2017 - journals.iucr.org
Evolutionary pressure on residue interactions, intramolecular or intermolecular, that are
important for protein structure or function can lead to covariance between the two positions …

[HTML][HTML] In silico prediction of structure and function for a large family of transmembrane proteins that includes human Tmem41b

S Mesdaghi, DL Murphy, FS Rodríguez… - …, 2020 - ncbi.nlm.nih.gov
Background: Recent strides in computational structural biology have opened up an
opportunity to understand previously uncharacterised proteins. The under-representation of …

ConDo: protein domain boundary prediction using coevolutionary information

SH Hong, K Joo, J Lee - Bioinformatics, 2019 - academic.oup.com
Motivation Domain boundary prediction is one of the most important problems in the study of
protein structure and function. Many sequence-based domain boundary prediction methods …

[HTML][HTML] A structured-based model for the decreased activity of Ala222Val and Glu429Ala methylenetetrahydrofolate reductase (MTHFR) mutants

K Shahzad, A Hai, A Ahmed, N Kizilbash… - Bioinformation, 2013 - ncbi.nlm.nih.gov
The structure of human Methylenetetrahydrofolate Reductase (MTHFR) is not known either
by NMR or by X-ray methods. Phosphorylation seems to play an important role in the …

Potential DNA binding and nuclease functions of ComEC domains characterized in silico

JA Baker, F Simkovic, HMC Taylor… - Proteins: Structure …, 2016 - Wiley Online Library
Bacterial competence, which can be natural or induced, allows the uptake of exogenous
double stranded DNA (dsDNA) into a competent bacterium. This process is known as …

Prediction of contacts from correlated sequence substitutions

WR Taylor, RS Hamilton, MI Sadowski - Current opinion in structural …, 2013 - Elsevier
Recent work has led to a substantial improvement in the accuracy of predictions of contacts
between amino acids using evolutionary information derived from multiple sequence …

Opportunities and limitations in applying coevolution-derived contacts to protein structure prediction

S Tetchner, T Kosciolek, DT Jones - Bio-Algorithms and Med …, 2014 - degruyter.com
The prospect of identifying contacts in protein structures purely from aligned protein
sequences has lured researchers for a long time, but progress has been modest until …

ConPlot: web-based application for the visualization of protein contact maps integrated with other data

F Sánchez Rodríguez, S Mesdaghi, AJ Simpkin… - …, 2021 - academic.oup.com
Covariance-based predictions of residue contacts and inter-residue distances are an
increasingly popular data type in protein bioinformatics. Here we present ConPlot, a web …

[PDF][PDF] Residue contacts predicted by evolutionary covariance extend the application of ab initio molecular replacement to larger and more challenging protein folds

F Simkovic, JMH Thomas, RM Keegan, MD Winn… - IUCrJ, 2016 - journals.iucr.org
For many protein families, the deluge of new sequence information together with new
statistical protocols now allow the accurate prediction of contacting residues from sequence …